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(E)-7-keto-7-phenyl-hept-5-enal
SpectraBase Compound ID 1I2ItXOL3xJ
InChI InChI=1S/C13H14O2/c14-11-7-2-1-6-10-13(15)12-8-4-3-5-9-12/h3-6,8-11H,1-2,7H2/b10-6+
InChIKey WRMUBRONHKSDEL-UXBLZVDNSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AnRaCv2SpL
Name 7-Oxo-7-phenyl-hept-5-enal
Alternate Name(s) (E)-7-oxo-7-phenylhept-5-enal (E)-7-oxo-7-phenyl-5-heptenal (E)-7-oxo-7-phenyl-hept-5-enal (E)-7-oxidanylidene-7-phenyl-hept-5-enal
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Formula C13H14O2
InChI InChI=1S/C13H14O2/c14-11-7-2-1-6-10-13(15)12-8-4-3-5-9-12/h3-6,8-11H,1-2,7H2/b10-6+
InChIKey WRMUBRONHKSDEL-UXBLZVDNSA-N
Literature Reference DOI 10.1021/ol9014943
Molecular Weight 202.253 g/mol
SMILES c1(ccccc1)C(\C=C\CCCC=O)=O
SPLASH splash10-0a6s-7900000000-507e58a7b3ed79f1b8c0
Source of Spectrum A1-11-3778/SMS8-11
Wiley ID 1757194